ID: 33769
SMILES:C1(C)=CC(c2c(O)ccc(CCCCC)c2)C(C(CO)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.288
InChIKey:NYGVKNCKQXHHOO-UHFFFAOYSA-N
ID: 33770
SMILES:C1(C)(C)Oc2c(ccc(CCCCC)c2O)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -16.217
InChIKey:MDPJPMNKDQHDOY-UHFFFAOYSA-N
ID: 33771
SMILES:CC1(C)C2CC3C(C)(Oc4c(c(O)cc(CCCCC)c4)C3CC2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -14.293
InChIKey:NHXXISOMQRCUIU-UHFFFAOYSA-N
ID: 33772
SMILES:C1C(C)(C)Oc2cc(CCCCC)cc(OC)c2C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.392
CB1 binding score: -16.904
InChIKey:YDKQBMBXJKVZPL-UHFFFAOYSA-N
ID: 33773
SMILES:C1C=C(C)C(CCC2(C)Oc3cc(CCCCC)cc(O)c3CC2=O)C(C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -15.977
InChIKey:ILLONQHSWMXDJG-UHFFFAOYSA-N
ID: 33774
SMILES:C=C(C)C1C23C(c4c(cc(CCCCC)cc4O)OC2)CCC(C)(C3C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -11.491
InChIKey:JDWGFSBZLNGLLQ-UHFFFAOYSA-N
ID: 33775
SMILES:c1(CC=C(C)CCC=C(CC=CC(C)C)C)c(O)c2c(cc1C)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.718
CB1 binding score: -14.624
InChIKey:CUCZBQAHIFUBEY-UHFFFAOYSA-N
ID: 33776
SMILES:Oc1c(OC)c(C(=O)C(CC)C)c(O)c(-c2c(O)cccc2)c1C(Oc1cc(CCCCC)cc2c1OC(C)(C)C1CC=C(C)CC21)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 656.816
CB1 binding score: -16.502
InChIKey:RVSSVSRRDRVBHI-UHFFFAOYSA-N
ID: 33777
SMILES:C(Cc1cc(O)c(C2C(C(C)C)CCC(C)=C2)c(O)c1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -18.479
InChIKey:QHFVULIOBFWRAD-UHFFFAOYSA-N
ID: 33778
SMILES:C(CCCC)c1cc(O)cc2c1C1C(C(C)(C)O2)CCO1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -17.321
InChIKey:TVDODOGCTDXUHM-UHFFFAOYSA-N
ID: 33779
SMILES:C(CCCC)c1cc(O)c(C2C(C(C)C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 33780
SMILES:C1(C)=CC2C3c4c(cc(CCCCC)cc4O)OC(C)(C)C3CC1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.554
InChIKey:BDOPODSABGQRJH-UHFFFAOYSA-N
ID: 33781
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(O)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 33782
SMILES:CC(=CCC1C(c2cc(O)c(C3C(C(C)C)CCC(C)=C3)c(O)c2)C(OC)C(C(C)(C)O)O1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.666
CB1 binding score: -16.211
InChIKey:AMFKXLGQURBHFV-UHFFFAOYSA-N
ID: 33783
SMILES:C1OC2(C=C(C)C1)OC(CCCC(=CCc1c(O)ccc(O)c1)C)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -15.116
InChIKey:MQLZINKCDJWLHB-UHFFFAOYSA-N
ID: 33784
SMILES:Cc1c2c(cc(C3C4(C(C)CC(C(C(C)C)C)O)OC43)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.652
CB1 binding score: -14.685
InChIKey:ZZSRYAVLRVQMLZ-UHFFFAOYSA-N
ID: 33785
SMILES:CC(=CCCC1(C)Oc2c(c(O)cc(CCCCC)c2)C=C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 33786
SMILES:c1(CCCCC)cc2c3c(c1)OCOC3CC1C(C)(CCCC1(C)C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -14.239
InChIKey:IGBLKWCSPJDEGW-UHFFFAOYSA-N
ID: 33787
SMILES:O=C(OC1C2C(C(C)(C)Oc3cc(CCc4ccc(O)cc4)ccc13)CCC2CCCCC(=O)O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.628
CB1 binding score: -15.609
InChIKey:AQXIMIZUYVMHCT-UHFFFAOYSA-N
ID: 33788
SMILES:C(=CCc1cc(O)c(O)cc1-c1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.494
CB1 binding score: -14.983
InChIKey:SDTRGCXKHVCYPK-UHFFFAOYSA-N
ID: 33789
SMILES:O=c1cc2c(cc(CCCC)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -12.523
InChIKey:BFKCZOIWQAUCMX-UHFFFAOYSA-N